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Octaethyltetraphenylporphyrin | CAS 63511-61-5
| Catalog Number | A14-0039 |
| Category | Calcium, Chloride and Other indicators |
| Molecular Formula | C60H62N4 |
| Molecular Weight | 839.184 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
Octaethyltetraphenylporphyrin is a synthetic compound that finds extensive applications in the biomedicine industry. Its multifaceted role encompasses the advancement of photodynamic therapy, a promising technique deployed in tackling diverse ailments, notably cancer. Possessing a distinctive configuration and adeptness in light absorption, this compound demonstrates exceptional capabilities in selectively homing in on cancer cells, obliterating them effectively upon activation by specific wavelengths.
Chemical Information
Product Specification
Application
Computed Properties
Patents
| Synonyms | 2,3,7,8,12,13,17,18-(octaethyl)-5,10,15,20-(tetraphenyl)porphyrin |
| IUPAC Name | 2,3,7,8,12,13,17,18-octaethyl-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin |
| Canonical SMILES | CCC1=C(C2=C(C3=NC(=C(C4=NC(=C(C5=C(C(=C(N5)C(=C1N2)C6=CC=CC=C6)CC)CC)C7=CC=CC=C7)C(=C4CC)CC)C8=CC=CC=C8)C(=C3CC)CC)C9=CC=CC=C9)CC |
| InChI | InChI=1S/C60H62N4/c1-9-41-42(10-2)54-50(38-31-23-18-24-32-38)56-45(13-5)46(14-6)58(63-56)52(40-35-27-20-28-36-40)60-48(16-8)47(15-7)59(64-60)51(39-33-25-19-26-34-39)57-44(12-4)43(11-3)55(62-57)49(53(41)61-54)37-29-21-17-22-30-37/h17-36,61-62H,9-16H2,1-8H3 |
| InChIKey | WSLROFYBZYXMQH-UHFFFAOYSA-N |
| Storage | Store at -20°C |
Octaethyltetraphenylporphyrin (OETPP), a synthetic porphyrin compound, finds significant applications across scientific and industrial domains. Here are four key applications of Octaethyltetraphenylporphyrin:
Photodynamic Therapy: Positioned at the forefront of cancer treatment, Octaethyltetraphenylporphyrin plays a pivotal role in photodynamic therapy (PDT). By administering OETPP, which selectively accumulates in cancer cells, light activation triggers the generation of reactive oxygen species that target and obliterate tumor cells. This precise targeting minimizes harm to healthy tissues, offering a tantalizing alternative to traditional cancer therapies.
Organic Electronics: Within the realm of organic electronics, OETPP emerges as a crucial component in organic photovoltaic (OPV) cells and organic light-emitting diodes (OLEDs). Leveraging its structural properties, OETPP facilitates efficient light absorption and electron transfer, essential for enhancing the performance of these devices. Researchers are actively exploring avenues to optimize OETPP-based materials, striving to elevate the efficiency and sustainability of electronic applications.
Chemical Sensors: The utility of Octaethyltetraphenylporphyrin extends to the realm of chemical sensor development, thanks to its selective binding capabilities with various analytes, including gases like oxygen and nitrogen dioxide. By detecting alterations in optical properties upon binding, these sensors offer real-time detection and monitoring of environmental pollutants. This application serves as a linchpin in the realms of environmental science and industrial safety monitoring.
Catalysis: Functioning as a catalyst in diverse chemical reactions, OETPP plays a pivotal role in oxidation and polymerization processes. Its porphyrin structure enables versatile reactivity and coordination with metal ions, facilitating the conversion of substrates into desired products.
| XLogP3 | 15 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 12 |
| Exact Mass | 838.49744799 g/mol |
| Monoisotopic Mass | 838.49744799 g/mol |
| Topological Polar Surface Area | 57.4Ų |
| Heavy Atom Count | 64 |
| Formal Charge | 0 |
| Complexity | 1190 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
| Publication Number | Title | Priority Date |
|---|---|---|
| US-2020207895-A1 | Radically polymerizable compositions | 2019-01-02 |
| WO-2020142632-A1 | Radically polymerizable compositions | 2019-01-02 |
| EP-3906265-A1 | Radically polymerizable compositions | 2019-01-02 |
| US-11518834-B2 | Radically polymerizable compositions | 2019-01-02 |
| US-2016205925-A1 | Antimicrobial compositions made of a thermoplastic polymer and a photosensitizer | 2015-01-15 |
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